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n-Hexyl .alpha.-methyltridecanoate
SpectraBase Compound ID 9NhxwyYbrLM
InChI InChI=1S/C20H40O2/c1-4-6-8-10-11-12-13-14-15-17-19(3)20(21)22-18-16-9-7-5-2/h19H,4-18H2,1-3H3
InChIKey CLRBIBHBZJDMKP-UHFFFAOYSA-N
Mol Weight 312.5 g/mol
Molecular Formula C20H40O2
Exact Mass 312.302831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4UmoWcMC2qy
Name n-Hexyl .alpha.-methyltridecanoate
Alternate Name(s) .alpha.-N-methyl hexyltridecanoate Hexyl 2-methyltridecanoate n-Hexyl alpha.-methyltridecanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H40O2
InChI InChI=1S/C20H40O2/c1-4-6-8-10-11-12-13-14-15-17-19(3)20(21)22-18-16-9-7-5-2/h19H,4-18H2,1-3H3
InChIKey CLRBIBHBZJDMKP-UHFFFAOYSA-N
Molecular Weight 312.538 g/mol
SMILES C(=O)(C(CCCCCCCCCCC)C)OCCCCCC
SPLASH splash10-0a70-7951000000-1a2c51f0a399abcd6db3
Source of Spectrum KZ-181-470-9
Wiley ID 46558